⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11272407 | 0.77 | — | — | |
| SCHEMBL7937128 | 0.67 | — | — | |
| SCHEMBL1881128 | 0.59 | — | — | |
| SCHEMBL9458897 | 0.56 | — | — | |
| SCHEMBL1384620 | 0.54 | — | — | |
| SCHEMBL10993091 | 0.49 | — | — | |
| SCHEMBL29496072 | 0.49 | — | — | |
| SCHEMBL5888763 | 0.48 | — | — | |
| Ethylene SCHEMBL27715093 | 0.48 | ALOX12 (0.39) | — | |
| Ethylene SCHEMBL8984236 | 0.48 | ALOX12 (0.39) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0004172-B1 | BENZOCYCLOHEPTAPYRANS, THEIR PREPARATION AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM | ELI LILLY AND COMPANY (US) | 1982-04-07 | — | — | EP | claimed |
| EP-0004172-B1 | BENZOCYCLOHEPTAPYRANS, THEIR PREPARATION AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM | ELI LILLY AND COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |
| EP-0004172-B1 | BENZOCYCLOHEPTAPYRANS, THEIR PREPARATION AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM | ELI LILLY AND COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |
| US-4195024-A | HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | disclosed |
| US-4195024-A | HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | disclosed |
| US-4195024-A | HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | disclosed |
| EP-0004172-A1 | Benzocycloheptapyrans, their preparation and pharmaceutical formulations containing them | ELI LILLY AND COMPANY (US) | 1979-09-19 | — | — | EP | disclosed |
| EP-0004172-A1 | Benzocycloheptapyrans, their preparation and pharmaceutical formulations containing them | ELI LILLY AND COMPANY (US) | 1979-09-19 | — | — | EP | disclosed |
| EP-0004172-A1 | Benzocycloheptapyrans, their preparation and pharmaceutical formulations containing them | ELI LILLY AND COMPANY (US) | 1979-09-19 | — | — | EP | disclosed |
| US-4152451-A | HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1979-05-01 | — | — | US | disclosed |
| US-4152451-A | HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1979-05-01 | — | — | US | disclosed |
| US-4152451-A | HYPOTENSIVE AGENTS | ELI LILLY AND COMPANY (US) | 1979-05-01 | — | — | US | disclosed |